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Ligand

NameCHEMBL1210154
Molecular formulaC19H16N2O2S
IUPAC name[(E)-1-(3-thiophen-2-ylphenyl)ethylideneamino] N-phenylcarbamate
Molecular weight336.409
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.7
Synonyms1-(3-Thiophen-2-yl-phenyl)-ethanone, O-(phenylaminocarbonyl)oxime
BDBM50323040
SCHEMBL13626452
Inchi KeyCQUWKHKELQQYRI-KGENOOAVSA-N
Inchi IDInChI=1S/C19H16N2O2S/c1-14(21-23-19(22)20-17-9-3-2-4-10-17)15-7-5-8-16(13-15)18-11-6-12-24-18/h2-13H,1H3,(H,20,22)/b21-14+
PubChem CID44469677
ChEMBLCHEMBL1210154
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 39
Page:  / 2 

GLASS IDNameUniProtGeneSpeciesLength
484375-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
484525-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
484285-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
484445-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
484295-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
484505-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
48454Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
48445Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
443609Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318
48431B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391
48456Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
48440Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
48448C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355
48441C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
48422Cannabinoid receptor 1P47746Cnr1Mus musculus (Mouse)473
48430Cannabinoid receptor 2P47936Cnr2Mus musculus (Mouse)347
48423Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
48438D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
48421D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
48439Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427

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